Compensation effect. A DFT study of the activation of N2O over M-CHA (M = Fe2+, Co2+, RuO2+, RuO+)

Author(s): Lubomir Benco
Organisation(s): Computational Materials Physics
Journal: Journal of Catalysis
Volume: 298
Pages: 122-129
No. of pages: 8
ISSN: 0021-9517
DOI: https://doi.org/10.1016/j.jcat.2012.11.002
Publication date: 2013
Peer reviewed: Yes
Austrian Fields of Science 2012: 103009 Solid state physics, 103015 Condensed matter, 103025 Quantum mechanics, 103036 Theoretical physics
Portal url: https://ucrisportal.univie.ac.at/en/publications/5bd48562-e4f8-49b4-b047-d41aa0e6e0e2

Compensation effect. A DFT study of the activation of N<sub>2</sub>O over M-CHA (M = Fe<sup>2+</sup>, Co<sup>2+</sup>, RuO<sup>2+</sup>, RuO<sup>+</sup>)